Geometry & MOs

Info

ID:	121790
PubChem CID:	50781372
Reduced:	O2N6C25H32 (1)
Stoich.:	A2B6C25D32 (1)
Weight, g/mol:	467.232125
ΔH_f, kcal/mol:	-14.93
Dipole, Da:	2.93
IP(EA), eV:	-8.51(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-benzyl-3-oxopyrido[2,3-b]pyrazin-2-yl)-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=CC=N2)N=C(C1=O)N3CCCC(C3)C(=O)NCCN(C)CC4=CC=CC=C4

DOS

IR

Vibrations